Canonical SMILES: O=C(O)CC[C@H](NC(=O)N[C@@H](CCCCNC(=O)c1ccc(CNC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H]2CC[C@H](CNC(=O)CN3CCN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CC3)CC2)cc1)C(=O)O)C(=O)O
Standard InChI: InChI=1S/C57H78N10O17/c68-47(33-64-21-23-65(34-49(71)72)25-27-67(36-51(75)76)28-26-66(24-22-64)35-50(73)74)59-31-37-10-16-42(17-11-37)53(78)61-46(30-39-12-13-40-5-1-2-6-43(40)29-39)54(79)60-32-38-8-14-41(15-9-38)52(77)58-20-4-3-7-44(55(80)81)62-57(84)63-45(56(82)83)18-19-48(69)70/h1-2,5-6,8-9,12-15,29,37,42,44-46H,3-4,7,10-11,16-28,30-36H2,(H,58,77)(H,59,68)(H,60,79)(H,61,78)(H,69,70)(H,71,72)(H,73,74)(H,75,76)(H,80,81)(H,82,83)(H2,62,63,84)/t37-,42-,44-,45-,46-/m0/s1
Standard InChI Key: PYNMGIJGABHYOJ-GRTBUXBVSA-N
Molfile:
RDKit 2D
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